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BDBM50438280 CHEMBL2408409

SMILES: Clc1ccc(Nc2ncc3CCCCc3n2)cc1

InChI Key: InChIKey=WCVSUUTWFGVKIY-UHFFFAOYSA-N

Data: 1 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50438280   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Metabotropic glutamate receptor 5


(Homo sapiens (Human))
BDBM50438280
PNG
(CHEMBL2408409)
Show SMILES Clc1ccc(Nc2ncc3CCCCc3n2)cc1
Show InChI InChI=1S/C14H14ClN3/c15-11-5-7-12(8-6-11)17-14-16-9-10-3-1-2-4-13(10)18-14/h5-9H,1-4H2,(H,16,17,18)
PDB
MMDB

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Similars

Article
PubMed
n/an/a 4.71E+3n/an/an/an/an/an/a



Merz Pharmaceuticals GmbH

Curated by ChEMBL


Assay Description
Negative allosteric modulation of human mGluR5 expressed in CHO cells assessed as inhibition of L-quisqualate-induced intracellular cAMP accumulation...


Bioorg Med Chem Lett 23: 4493-500 (2013)


Article DOI: 10.1016/j.bmcl.2013.06.049
BindingDB Entry DOI: 10.7270/Q2KD20B8
More data for this
Ligand-Target Pair